5-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-1H-pyrazin-2-one

C11H16N4O3 — CID 43501386

IUPAC5-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-1H-pyrazin-2-one
SMILESO=C(c1c[nH]c(=O)cn1)N1CCN(CCO)CC1
InChIInChI=1S/C11H16N4O3/c16-6-5-14-1-3-15(4-2-14)11(18)9-7-13-10(17)8-12-9/h7-8,16H,1-6H2,(H,13,17)
InChIKeyZPAZUBGILVMAGG-UHFFFAOYSA-N
MW252.27 g/mol
LogP-1.48
Rot. Bonds3

About 5-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-1H-pyrazin-2-one

5-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-1H-pyrazin-2-one (PubChem CID 43501386) has the molecular formula C11H16N4O3 and a molecular weight of 252.27 g/mol. Its IUPAC name is 5-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-1H-pyrazin-2-one.

Molecular Properties

Compound Name5-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-1H-pyrazin-2-one
PubChem CID43501386
Molecular FormulaC11H16N4O3
Molecular Weight252.27 g/mol
Exact Mass252.12
IUPAC Name5-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-1H-pyrazin-2-one
SMILESO=C(c1c[nH]c(=O)cn1)N1CCN(CCO)CC1
InChIInChI=1S/C11H16N4O3/c16-6-5-14-1-3-15(4-2-14)11(18)9-7-13-10(17)8-12-9/h7-8,16H,1-6H2,(H,13,17)
InChIKeyZPAZUBGILVMAGG-UHFFFAOYSA-N
XLogP-1.48
TPSA89.53 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 5-1.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-6-oxo-1H-pyrazine-3-carboxamide
CID 107483149
N-(2-hydroxyethyl)-6-oxo-N-(2,2,2-trifluoroethyl)-1H-pyrazine-3-carboxamide
CID 113351102
N-[2-[4-(1,2-dihydropyrazine-5-carbonyl)piperazin-1-yl]ethyl]acetamide
CID 70289449
5-(piperazine-1-carbonyl)-1H-pyrazin-2-one
CID 28788615
6-oxo-N-(3-piperazin-1-ylpropyl)-1H-pyrazine-3-carboxamide
CID 43443306
N-(1-hydroxy-2-methylpropan-2-yl)-6-oxo-1H-pyrazine-3-carboxamide
CID 43500503
N-(2-hydroxyethyl)-6-oxo-1H-pyrazine-3-carboxamide
CID 43501009
N-(1-hydroxypropan-2-yl)-6-oxo-1H-pyrazine-3-carboxamide
CID 43501040
N-(2-hydroxypropyl)-6-oxo-1H-pyrazine-3-carboxamide
CID 43501130
5-(3-hydroxypiperidine-1-carbonyl)-1H-pyrazin-2-one
CID 43502671
2-[4-(6-oxo-1H-pyrazine-3-carbonyl)piperazin-1-yl]acetic acid
CID 43521411
N-(2-hydroxyethyl)-6-oxo-N-propan-2-yl-1H-pyrazine-3-carboxamide
CID 43572995

Frequently Asked Questions

What is the IUPAC name of 5-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-1H-pyrazin-2-one?
The IUPAC name of 5-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-1H-pyrazin-2-one (CID 43501386) is 5-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-1H-pyrazin-2-one.
What is the SMILES notation for 5-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-1H-pyrazin-2-one?
The canonical SMILES for 5-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-1H-pyrazin-2-one is O=C(c1c[nH]c(=O)cn1)N1CCN(CCO)CC1.
What is the InChIKey of 5-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-1H-pyrazin-2-one?
The InChIKey is ZPAZUBGILVMAGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O3/c16-6-5-14-1-3-15(4-2-14)11(18)9-7-13-10(17)8-12-9/h7-8,16H,1-6H2,(H,13,17).
What are the key properties of 5-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-1H-pyrazin-2-one?
5-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-1H-pyrazin-2-one has a molecular weight of 252.27 g/mol, XLogP of -1.48, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-1H-pyrazin-2-one is sourced from PubChem (CID 43501386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).